Min Pa: Min Pa(max): Activity's type:

Ext Pa Pi Pmax Activity Other Results ID Pa_max
0.7950.0040.8395 Hydroxytryptamine release stimulant

0.839 0.003 CID_12297

CID_12297
0.7630.0160.763Caspase 9 stimulant

0.665 0.028 CID_12297

0.7080.0080.806Aldehyde oxidase inhibitor

0.806 0.004 CID_12297

CID_12297
0.6750.0040.675GABA C receptor rho-3 antagonist

0.489 0.029 CID_12297

0.6440.0060.6445 Hydroxytryptamine release inhibitor

0.643 0.006 CID_12297

0.6080.0040.681Alpha-N-acetylglucosaminidase inhibitor

0.681 0.003 CID_12297

CID_12297
0.6060.0180.687Cholesterol antagonist

0.687 0.009 CID_12297

CID_12297
0.5750.0030.5755 Hydroxytryptamine uptake stimulant

0.44 0.008 CID_12297

0.5530.0090.553Superoxide dismutase inhibitor

0.425 0.023 CID_12297

0.5540.0160.741Immunomodulator

0.741 0.005 CID_12297

CID_12297
0.5410.0030.636Alcohol oxidase inhibitor

0.636 0.003 CID_12297

CID_12297
0.5420.0070.542Peroxidase inhibitor

0.539 0.007 CID_12297

0.5350.0030.535Electron transport complex I inhibitor

0.509 0.003 CID_12297

0.550.0210.664Vasodilator, peripheral

0.664 0.009 CID_12297

CID_12297
0.5410.0180.57Histamine release inhibitor

0.57 0.013 CID_12297

CID_12297
0.5310.0250.575Immunosuppressant

0.575 0.016 CID_12297

CID_12297
0.5150.0110.621Hypolipemic

0.621 0.005 CID_12297

CID_12297
0.5080.0070.53Anesthetic general

0.53 0.006 CID_12297

CID_12297
0.520.0250.52Ca2+/calmodulin-dependent protein kinase kinase A inhibitor

0.366 0.133 CID_12297

0.4880.0030.524Succinate dehydrogenase inhibitor

0.524 0.003 CID_12297

CID_12297
0.4640.0040.464GABA C receptor agonist

0.304 0.009 CID_12297

0.4650.0040.465Tyrosine 3 hydroxylase inhibitor

0.331 0.021 CID_12297

0.4720.0120.489Interleukin 2 agonist

0.489 0.009 CID_12297

CID_12297
0.4580.0030.458Ferrochelatase inhibitor

0.354 0.005 CID_12297

0.4430.0170.57Vasodilator

0.57 0.007 CID_12297

CID_12297
0.4270.0030.427GABA C receptor antagonist

0.319 0.004 CID_12297

0.4220.0050.422DNA polymerase I inhibitor

0.252 0.017 CID_12297

0.4230.0090.457Phospholipase C inhibitor

0.457 0.008 CID_12297

CID_12297
0.4230.0170.423Calcium channel activator

0.351 0.049 CID_12297

0.420.0160.487Interleukin agonist

0.487 0.01 CID_12297

CID_12297
0.4180.020.418Psychostimulant

0.324 0.037 CID_12297

0.3970.0180.397RNA-directed DNA polymerase inhibitor

0.358 0.023 CID_12297

0.4190.0450.593Antithrombotic

0.593 0.017 CID_12297

CID_12297
0.4060.0330.457Vasodilator, coronary

0.457 0.022 CID_12297

CID_12297
0.3740.0030.374Acetyl-CoA transferase inhibitor

0.096 0.014 CID_12297

0.4160.0530.416Calpain 2 inhibitor
0.3840.0240.384Angiogenesis stimulant

0.271 0.061 CID_12297

0.3810.0240.381Sodium/bile acid cotransporter inhibitor

0.362 0.033 CID_12297

0.3790.0320.408Platelet antagonist

0.408 0.025 CID_12297

CID_12297
0.3520.0040.358Adenylate kinase inhibitor

0.358 0.004 CID_12297

CID_12297
0.3670.0210.367Growth hormone agonist

0.299 0.032 CID_12297

0.3540.0090.354Gastrin inhibitor

0.322 0.02 CID_12297

0.4380.0960.438Apoptosis agonist

0.398 0.115 CID_12297

0.3470.0080.436Aldehyde dehydrogenase inhibitor

0.436 0.005 CID_12297

CID_12297
0.3440.0060.344Interleukin 4 antagonist

0.286 0.009 CID_12297

0.360.0230.477Cyclic AMP phosphodiesterase inhibitor

0.477 0.008 CID_12297

CID_12297
0.3560.0290.363DNA synthesis inhibitor

0.363 0.028 CID_12297

CID_12297
0.3270.0040.327GABA C receptor rho-2 antagonist

0.192 0.034 CID_12297

0.3230.0070.323Neurotrophic factor

0.294 0.008 CID_12297

0.3170.0030.317GABA C receptor rho-1 antagonist

0.26 0.004 CID_12297

0.3690.0590.48Immunostimulant

0.48 0.032 CID_12297

CID_12297
0.430.1210.646Antiinflammatory

0.646 0.042 CID_12297

CID_12297
0.3220.0130.322Neurotrophic factor enhancer

0.286 0.022 CID_12297

0.3310.0240.331Dual specificity phosphatase inhibitor

0.163 0.081 CID_12297

0.3120.0050.312Porphobilinogen synthase inhibitor

0.165 0.017 CID_12297

0.310.0040.31Vanilloid agonist

0.143 0.012 CID_12297

0.3070.0040.307Creatine kinase inhibitor

0.21 0.009 CID_12297

0.320.0180.32Lipocortins synthesis antagonist

0.196 0.059 CID_12297

0.3190.0180.319Glyceraldehyde-3-phosphate dehydrogenase inhibitor

0.272 0.033 CID_12297

0.3140.0150.344Protein kinase stimulant

0.344 0.012 CID_12297

CID_12297
0.350.0560.368Apoptosis antagonist

0.368 0.048 CID_12297

CID_12297
0.2970.0060.346UDP-N-acetylglucosamine 1-carboxyvinyltransferase inhibitor

0.346 0.005 CID_12297

CID_12297
0.3140.0260.314Dual specificity phosphatase 3 inhibitor

0.181 0.073 CID_12297

0.3390.0560.508Spasmolytic

0.508 0.022 CID_12297

CID_12297
0.3260.0440.326Insulysin inhibitor

0.265 0.083 CID_12297

0.3710.090.476Antibacterial

0.476 0.048 CID_12297

CID_12297
0.2970.0190.397Lipid peroxidase inhibitor

0.397 0.01 CID_12297

CID_12297
0.3040.0270.3045 Hydroxytryptamine 1E antagonist
0.3090.0350.309Ca(v)3.3 blocker
0.2850.0110.285UDP-glucose 4-epimerase inhibitor

0.284 0.011 CID_12297

0.2740.0040.274Prolactin inhibitor

0.203 0.008 CID_12297

0.3040.0350.304Platelet aggregation inhibitor

0.26 0.048 CID_12297

0.2910.0210.389Interferon gamma antagonist

0.389 0.011 CID_12297

CID_12297
0.2720.0060.31Triose-phosphate isomerase inhibitor

0.31 0.005 CID_12297

CID_12297
0.2730.0060.307Phosphofructokinase-1 inhibitor

0.307 0.005 CID_12297

CID_12297
0.2750.0090.275Death-associated protein kinase 2 inhibitor
0.2730.0070.325Catalase inhibitor

0.325 0.005 CID_12297

CID_12297
0.2680.0050.268Photosensitizer

0.169 0.022 CID_12297

0.2770.0150.383Anesthetic local

0.383 0.007 CID_12297

CID_12297
0.3410.080.341Transcription factor NF kappa B inhibitor

0.298 0.095 CID_12297

0.2740.0190.274Nitric-oxide synthase stimulant

0.274 0.019 CID_12297

0.2640.0110.2645 Hydroxytryptamine 3E antagonist

0.168 0.143 CID_12297

0.2530.0030.271Acyl-CoA dehydrogenase inhibitor

0.271 0.002 CID_12297

CID_12297
0.2870.0380.287Platelet adhesion inhibitor

0.163 0.093 CID_12297

0.2520.0050.252Argininosuccinate synthase inhibitor

0.188 0.008 CID_12297

0.250.0030.25Acetyl-CoA transferase 1 inhibitor

0.051 0.015 CID_12297

0.2510.0040.251Sphingosine 1-phosphate receptor 2 antagonist

0.197 0.008 CID_12297

0.2590.0130.259Cathepsin H inhibitor

0.242 0.014 CID_12297

0.250.0050.25Arachidonic acid antagonist

0.238 0.009 CID_12297

0.2810.0410.281Calpain inhibitor

0.174 0.143 CID_12297

0.2440.0050.244Sphingosine 1-phosphate receptor 4 antagonist

0.192 0.011 CID_12297

0.2430.0050.243Electrolyte absorption antagonist

0.203 0.008 CID_12297

0.2960.0580.296DNA damaging

0.229 0.094 CID_12297

0.2460.010.246Nav1.6 sodium channel blocker

0.176 0.031 CID_12297

0.2410.0040.241Sphingosine 1-phosphate receptor 5 antagonist

0.204 0.01 CID_12297

0.2590.0230.259Bone formation stimulant

0.253 0.024 CID_12297

0.3410.1050.34115-Lipoxygenase inhibitor
0.2720.0370.272Neuropeptide Y2 antagonist

0.255 0.051 CID_12297

0.2450.010.284Toll-Like receptor 2 antagonist

0.284 0.005 CID_12297

CID_12297
0.2620.0280.3Insulin sensitizer

0.3 0.016 CID_12297

CID_12297
0.2350.0050.252Sphingomyelinase inhibitor

0.252 0.004 CID_12297

CID_12297
0.2370.0060.237TRPA1 agonist

0.219 0.008 CID_12297

0.2340.0050.238Adenylate cyclase stimulant

0.238 0.005 CID_12297

CID_12297
0.230.0020.23Ca2+-transporting ATPase inhibitor

0.208 0.003 CID_12297

0.2440.0190.267Cholesterol synthesis inhibitor

0.267 0.015 CID_12297

CID_12297
0.2830.0590.5Hypoglycemic

0.5 0.015 CID_12297

CID_12297
0.2850.0610.297Transcription factor STAT3 inhibitor

0.297 0.055 CID_12297

CID_12297
0.2460.0240.253Phospholipase A2 inhibitor

0.253 0.023 CID_12297

CID_12297
0.2260.0050.279Interferon agonist

0.279 0.004 CID_12297

CID_12297
0.2360.0150.236Aminopeptidase B inhibitor

0.234 0.015 CID_12297

0.2450.0240.251Interleukin 6 antagonist

0.251 0.023 CID_12297

CID_12297
0.2850.0650.357Transcription factor STAT inhibitor

0.357 0.032 CID_12297

CID_12297
0.2830.0640.486Cardiotonic

0.486 0.017 CID_12297

CID_12297
0.2240.0040.224CDC25B inhibitor

0.057 0.056 CID_12297

0.2250.0060.225Thioredoxin inhibitor
0.2350.0180.249ATPase inhibitor

0.249 0.014 CID_12297

CID_12297
0.2570.040.361Non-steroidal antiinflammatory agent

0.361 0.018 CID_12297

CID_12297
0.2460.0290.298Melanin inhibitor

0.298 0.022 CID_12297

CID_12297
0.2250.010.263Alcohol dehydrogenase inhibitor

0.263 0.007 CID_12297

CID_12297
0.220.0050.22Toll-Like receptor 3 antagonist
0.2480.0340.248Thrombolytic

0.23 0.039 CID_12297

0.2310.0180.231Cystathionine beta-synthase inhibitor

0.152 0.04 CID_12297

0.2360.0240.245Nav1.2 sodium channel blocker

0.245 0.023 CID_12297

CID_12297
0.2240.0150.232Nav1.1 sodium channel blocker

0.232 0.014 CID_12297

CID_12297
0.2110.0020.211Calcium-dependent phospholipase A2 inhibitor

0.04 0.004 CID_12297

0.2170.0090.249Glutamate dehydrogenase inhibitor

0.249 0.007 CID_12297

CID_12297
0.2280.0210.228Cell wall synthesis inhibitor

0.22 0.023 CID_12297

0.2190.0110.219Calcium antagonist

0.177 0.016 CID_12297

0.2310.0240.231Neurotensin receptor agonist

0.167 0.066 CID_12297

0.2270.0220.227Histone deacetylase SIRT1 inhibitor

0.118 0.093 CID_12297

0.2110.0070.238Carbamoyl phosphate synthetase inhibitor

0.238 0.006 CID_12297

CID_12297
0.2180.0140.218CF transmembrane conductance regulator agonist

0.173 0.044 CID_12297

0.2090.0060.209CDC25A inhibitor

0.116 0.02 CID_12297

0.2340.0330.352Amylase inhibitor

0.352 0.013 CID_12297

CID_12297
0.2080.0060.217Glutamate decarboxylase inhibitor

0.217 0.005 CID_12297

CID_12297
0.2140.0140.214Carbonic anhydrase III inhibitor

0.133 0.036 CID_12297

0.230.0320.23Antipruritic

0.187 0.058 CID_12297

0.2070.010.213NADH dehydrogenase inhibitor

0.213 0.009 CID_12297

CID_12297
0.2010.0040.201Glycine receptor agonist

0.133 0.009 CID_12297

0.2070.010.207Vanilloid 1 agonist

0.196 0.013 CID_12297

0.2010.0050.201Acetylcholine release stimulant

0.132 0.032 CID_12297

0.2030.0070.207Ornithine carbamoyltransferase inhibitor

0.207 0.007 CID_12297

CID_12297
0.2780.0820.278Lipoxygenase inhibitor

0.225 0.118 CID_12297

0.1940.0040.194Glycine receptor antagonist

0.142 0.009 CID_12297

0.1950.0050.195Lanosterol 14 alpha demethylase inhibitor

0.167 0.007 CID_12297

0.2060.0160.206Falcipain 3 inhibitor

0.133 0.045 CID_12297

0.280.0920.2812-Lipoxygenase inhibitor
0.2050.0170.205Cyclooxygenase 3 inhibitor

0.177 0.029 CID_12297

0.2040.0180.204Carbonic anhydrase XV inhibitor

0.105 0.06 CID_12297

0.2050.0230.2055-Lipoxygenase inhibitor
0.1880.0060.188Lipase inhibitor

0.104 0.025 CID_12297

0.2170.0350.217Acetylcholine M1 receptor antagonist

0.171 0.057 CID_12297

0.2390.0610.239Anticonvulsant
0.1830.0070.189Biliverdin reductase inhibitor

0.189 0.006 CID_12297

CID_12297
0.1830.0090.199Toll-Like receptor 4 antagonist

0.199 0.006 CID_12297

CID_12297
0.1980.0250.198Nav1.3 sodium channel blocker

0.181 0.032 CID_12297

0.2790.1050.279Thyroid hormone antagonist
0.2090.0360.209Thiol protease inhibitor

0.167 0.056 CID_12297

0.2030.030.203Toll-Like receptor antagonist

0.147 0.058 CID_12297

0.1780.0050.178Sphingosine 1-phosphate receptor 4 agonist

0.151 0.008 CID_12297

0.1750.0060.175Glutamate release inhibitor

0.154 0.009 CID_12297

0.1730.0040.2Aconitate hydratase inhibitor

0.2 0.003 CID_12297

CID_12297
0.2260.0570.226DNA methyltransferase I inhibitor

0.223 0.058 CID_12297

0.1880.0190.1885 Hydroxytryptamine 3A agonist
0.2110.0430.211Cytidine deaminase inhibitor

0.176 0.059 CID_12297

0.1760.0080.176Anabolic

0.172 0.009 CID_12297

0.1910.0240.196Antibacterial (Helicobacter pylori)

0.196 0.023 CID_12297

CID_12297
0.170.0030.17Lysophosphatidic acid 2 receptor antagonist

0.117 0.004 CID_12297

0.180.0150.18Histidine decarboxylase inhibitor

0.172 0.016 CID_12297

0.1690.0070.169Ornithine decarboxylase inhibitor

0.149 0.011 CID_12297

0.1890.030.249Alkylator

0.249 0.017 CID_12297

CID_12297
0.1740.0150.174Heat shock protein 70 antagonist

0.146 0.056 CID_12297

0.1750.0160.178Sphingosine 1-phosphate receptor 2 agonist

0.178 0.015 CID_12297

CID_12297
0.2450.0870.345Antioxidant

0.345 0.048 CID_12297

CID_12297
0.1780.020.178Pregnane X receptor agonist

0.136 0.084 CID_12297

0.2650.1080.265Thyroid hormone beta antagonist
0.1610.0040.201Interferon inducer

0.201 0.003 CID_12297

CID_12297
0.1680.0140.168DOPA decarboxylase inhibitor

0.122 0.043 CID_12297

0.210.0560.21Histone acetyltransferase inhibitor
0.1790.0260.215Microtubule formation inhibitor

0.215 0.017 CID_12297

CID_12297
0.1810.0290.181Farnesoid X receptor antagonist
0.1970.0450.197Diuretic

0.164 0.066 CID_12297

0.1560.0050.156Granulocyte macrophage colony stimulating factor agonist

0.1 0.035 CID_12297

0.1710.0220.205Mucolytic

0.205 0.012 CID_12297

CID_12297
0.1670.020.167HIV-1 integrase (Overall Integration) inhibitor

0.092 0.063 CID_12297

0.1610.0140.161CYP2A6 inhibitor

0.072 0.056 CID_12297

0.2160.0690.228DNA methylase inhibitor

0.228 0.062 CID_12297

CID_12297
0.1550.0090.155Leukotriene synthesis inhibitor

0.112 0.02 CID_12297

0.220.0740.568Interleukin antagonist

0.568 0.014 CID_12297

CID_12297
0.1980.0530.1983C-like protease (Human coronavirus) inhibitor

0.134 0.133 CID_12297

0.1840.040.184Mannose-6-phosphate isomerase inhibitor

0.153 0.062 CID_12297

0.1480.0040.148Glutamate (mGluR6) antagonist

0.113 0.007 CID_12297

0.2720.1290.292Toll-Like receptor agonist

0.292 0.116 CID_12297

CID_12297
0.1440.0040.144Vanilloid 2 antagonist

0.091 0.006 CID_12297

0.1430.0030.165Glucose-6-phosphate isomerase inhibitor

0.165 0.002 CID_12297

CID_12297
0.1520.0120.166Aminopeptidase I inhibitor

0.166 0.01 CID_12297

CID_12297
0.1520.0130.152Histamine N-methyltransferase inhibitor
0.1610.0220.161Gastric antisecretory

0.136 0.033 CID_12297

0.1770.0380.239Monophenol monooxygenase inhibitor

0.239 0.025 CID_12297

CID_12297
0.1420.0040.142Sphingosine kinase 2 inhibitor

0.137 0.004 CID_12297

0.1520.0140.152Keratolytic

0.128 0.019 CID_12297

0.1420.0040.142Vanilloid 4 agonist

0.124 0.005 CID_12297

0.180.0420.19Hemostatic

0.19 0.037 CID_12297

CID_12297
0.1570.020.157Nitric-oxide synthase inhibitor

0.093 0.072 CID_12297

0.1630.0270.163Interleukin 8 antagonist

0.106 0.083 CID_12297

0.1390.0030.139Acetyl-CoA transferase 2 inhibitor

0.066 0.022 CID_12297

0.1770.0420.177NADPH oxidase inhibitor
0.1490.0130.177Peroxisome proliferator-activated receptor gamma agonist

0.177 0.008 CID_12297

CID_12297
0.1510.0160.151Inducible nitric-oxide synthase inhibitor

0.078 0.065 CID_12297

0.170.0360.17Proteasome inhibitor

0.157 0.042 CID_12297

0.1380.0040.138Phospholipase D inhibitor

0.104 0.013 CID_12297

0.1660.0330.166Histone deacetylase class III inhibitor
0.1670.0350.22Adenylate cyclase inhibitor

0.22 0.022 CID_12297

CID_12297
0.1380.0080.138Elastase 1 inhibitor

0.068 0.05 CID_12297

0.1790.0490.193Hexokinase inhibitor

0.193 0.039 CID_12297

CID_12297
0.1610.0310.311Expectorant

0.311 0.008 CID_12297

CID_12297
0.1380.0080.138Purinergic P2X1 antagonist

0.108 0.014 CID_12297

0.1330.0040.204Sphingosine kinase inhibitor

0.204 0.003 CID_12297

CID_12297
0.1420.0130.227Phenylalanine 4-hydroxylase inhibitor

0.227 0.005 CID_12297

CID_12297
0.1330.0040.194Alpha-mannosidase inhibitor

0.194 0.003 CID_12297

CID_12297
0.1420.0140.142Glutathione S-transferase inhibitor

0.119 0.023 CID_12297

0.1370.0090.137Cannabinoid CB2 receptor antagonist
0.1610.0330.161Beta amyloid protein antagonist
0.1490.0210.149Cathepsin G inhibitor

0.122 0.027 CID_12297

0.140.0120.188Toll-Like receptor 2 agonist

0.188 0.008 CID_12297

CID_12297
0.1560.030.216Bronchodilator

0.216 0.016 CID_12297

CID_12297
0.130.0040.13Glutamate (mGluR7) antagonist

0.094 0.014 CID_12297

0.1370.0120.137Cannabinoid CB1 receptor agonist
0.1520.0270.152Caspase 3 inhibitor

0.146 0.031 CID_12297

0.1390.0140.139Interleukin 5 antagonist

0.126 0.02 CID_12297

0.1360.0110.344Prostaglandin EP2 antagonist

0.344 0.004 CID_12297

CID_12297
0.1350.0110.135GABA aminotransferase inhibitor

0.103 0.025 CID_12297

0.140.0160.14Cannabinoid receptor antagonist
0.1350.0110.135Nicotinic alpha4beta2 receptor antagonist
0.2140.090.214Antiamyloidogenic

0.168 0.125 CID_12297

0.1280.0050.128Glucosylceramidase inhibitor

0.127 0.005 CID_12297

0.130.0070.13Estrogen-related receptor beta agonist

0.101 0.024 CID_12297

0.1310.0080.131Acetylcholine M5 receptor agonist

0.059 0.056 CID_12297

0.1250.0030.125Lysophosphatidic acid 3 receptor antagonist

0.123 0.004 CID_12297

0.1260.0050.126Sphingosine 1-phosphate receptor 3 antagonist

0.103 0.008 CID_12297

0.190.0710.323Hepatoprotectant

0.323 0.024 CID_12297

CID_12297
0.1230.0040.123Squalene epoxidase inhibitor

0.072 0.013 CID_12297

0.1480.0290.148Mediator release inhibitor

0.137 0.035 CID_12297

0.1230.0040.123Exportin-1 inhibitor

0.108 0.006 CID_12297

0.1450.0270.145Transcription factor STAT6 inhibitor
0.140.0230.14Carbonic anhydrase VI inhibitor

0.076 0.063 CID_12297

0.1270.010.141Mannitol-1-phosphate 5-dehydrogenase inhibitor

0.141 0.009 CID_12297

CID_12297
0.1230.0060.123Oleamide hydrolase inhibitor

0.076 0.014 CID_12297

0.1820.0660.182Tumour necrosis factor antagonist
0.1290.0140.129mTOR complex 2 inhibitor

0.107 0.026 CID_12297

0.1190.0040.132Cytokine production stimulant

0.132 0.003 CID_12297

CID_12297
0.2130.0980.464Tumour necrosis factor alpha release inhibitor

0.464 0.018 CID_12297

CID_12297
0.1190.0050.217Mannosidase inhibitor

0.217 0.003 CID_12297

CID_12297
0.1480.0350.148Nav1.4 sodium channel blocker
0.1180.0050.118Nicotinic alpha3beta2 receptor antagonist

0.05 0.043 CID_12297

0.1190.0060.119Cathepsin L2 inhibitor
0.1370.0240.137Carbonic anhydrase XIII inhibitor

0.09 0.043 CID_12297

0.1220.0090.186Neuraminidase inhibitor

0.186 0.004 CID_12297

CID_12297
0.1360.0240.136Interleukin 1 beta converting enzyme inhibitor

0.086 0.078 CID_12297

0.1170.0040.117Corticotropin releasing factor 2 receptor antagonist

0.076 0.021 CID_12297

0.130.0180.148Phosphodiesterase 6D inhibitor

0.148 0.01 CID_12297

CID_12297
0.1180.0060.118S-adenosyl-L-methionine decarboxylase inhibitor

0.08 0.037 CID_12297

0.1240.0130.124Acetylcholine muscarinic agonist
0.1380.0270.138Folate antagonist

0.094 0.076 CID_12297

0.150.040.15Death-associated protein kinase 1 inhibitor
0.1240.0140.124Carbonic anhydrase stimulant

0.077 0.027 CID_12297

0.1230.0150.123Amidase inhibitor

0.085 0.034 CID_12297

0.120.0130.12Sphingosine 1-phosphate receptor antagonist

0.096 0.025 CID_12297

0.1160.0090.116GABA B receptor agonist

0.104 0.014 CID_12297

0.1660.0590.669Insulin secretagoues

0.669 0.004 CID_12297

CID_12297
0.1190.0120.2Neuraminidase (influenza) inhibitor

0.2 0.005 CID_12297

CID_12297
0.1150.0080.115Bombesin 3 receptor antagonist
0.1430.0360.143Protein kinase C gamma inhibitor

0.094 0.089 CID_12297

0.1160.010.116CC chemokine 5 receptor agonist

0.08 0.065 CID_12297

0.1590.0530.159Neuropeptide Y1 antagonist
0.1230.0170.123Bile acid receptor antagonist

0.106 0.037 CID_12297

0.1090.0040.109Dopamine D5 agonist

0.055 0.014 CID_12297

0.1180.0140.118D-Ala-D-Ala ligase inhibitor

0.093 0.039 CID_12297

0.1450.0410.145Alpha 2b adrenoreceptor antagonist
0.110.0070.11Sphingosine 1-phosphate receptor 5 agonist

0.101 0.008 CID_12297

0.1170.0140.117NMDA receptor agonist

0.072 0.035 CID_12297

0.1160.0130.116Carbonic anhydrase VB inhibitor

0.059 0.036 CID_12297

0.1090.0060.109Potassium channel (Tandem pore domain) blocker

0.081 0.031 CID_12297

0.1140.0120.114Cannabinoid CB1 receptor antagonist

0.061 0.044 CID_12297

0.1210.0190.121Cannabinoid receptor agonist
0.110.0090.244Prostaglandin F2 alpha antagonist

0.244 0.003 CID_12297

CID_12297
0.1040.0030.104Geranyltranstransferase inhibitor

0.085 0.004 CID_12297

0.1330.0330.133Urease inhibitor
0.1080.0090.108Fatty acid synthase inhibitor

0.074 0.022 CID_12297

0.1250.0260.125Glutamate (mGluR7) agonist
0.120.0210.12Histamine H2 receptor antagonist
0.1020.0040.166Sphingosine kinase 1 inhibitor

0.166 0.003 CID_12297

CID_12297
0.1260.0280.126Acetylcholine nicotinic antagonist
0.1010.0040.101Delayed rectifier potassium channel blocker

0.038 0.025 CID_12297

0.1050.0080.105Potassium channel intermediate-conductance Ca-activated blocker
0.1090.0120.109Acetylcholine M1 receptor agonist
0.1350.0380.15AMP-activated protein kinase stimulant

0.15 0.028 CID_12297

CID_12297
0.1160.0190.116Na+ K+ transporting ATPase inhibitor

0.115 0.02 CID_12297

0.1440.0480.144Acetylcholine muscarinic antagonist

0.104 0.086 CID_12297

0.1150.0190.115Acetylcholine M4 receptor antagonist
0.1010.0050.135Fumarate hydratase inhibitor

0.135 0.004 CID_12297

CID_12297
0.1280.0340.128Acetylcholine agonist
0.1120.0180.112Caspase 7 inhibitor
0.0990.0050.105Calcium channel P-type blocker

0.105 0.005 CID_12297

CID_12297
0.1160.0230.125Selectin antagonist

0.125 0.021 CID_12297

CID_12297
0.1060.0130.106Potassium channel (ATP-sensitive) blocker
0.1810.0880.181I kappa B kinase epsilon inhibitor
0.0970.0040.097Ryanodine receptor antagonist

0.07 0.018 CID_12297

0.1020.0090.102Sphingosine 1-phosphate receptor 1 antagonist

0.085 0.013 CID_12297

0.0960.0040.096Pregnane X receptor antagonist

0.07 0.014 CID_12297

0.0970.0050.097Cholesterol esterase inhibitor

0.073 0.009 CID_12297

0.1840.0920.184MAP kinase kinase 2 inhibitor
0.1190.0280.119Phosphodiesterase I inhibitor
0.1370.0450.137DNA repair enzyme inhibitor
0.0940.0030.094Kainate receptor agonist

0.071 0.004 CID_12297

0.1050.0140.105NMDA receptor glycine site agonist

0.068 0.038 CID_12297

0.1060.0160.106TRPA1 antagonist
0.0950.0050.095AMPA 4 receptor antagonist

0.041 0.024 CID_12297

0.0950.0050.095Adenylate cyclase 1 inhibitor

0.071 0.011 CID_12297

0.1030.0140.124Beta 3 adrenoreceptor antagonist

0.124 0.009 CID_12297

CID_12297
0.0990.010.099Enoyl-[acyl-carrier-protein] reductase inhibitor
0.0930.0050.093Histamine H2 receptor agonist
0.0980.010.098Phosphodiesterase 1A inhibitor
0.1020.0150.102Protease 3C (Human rhinovirus) inhibitor

0.071 0.035 CID_12297

0.1430.0560.143Cholinergic antagonist
0.090.0040.09Membrane dipeptidase inhibitor

0.079 0.005 CID_12297

0.1030.0170.103Bombesin 1 receptor agonist
0.0950.0090.095Potassium channel Kv1.3 blocker
0.1030.0180.103Cannabinoid CB2 receptor agonist
0.1070.0230.107Adenosine A3 receptor antagonist

0.077 0.047 CID_12297

0.1180.0350.159Androgen antagonist

0.159 0.02 CID_12297

CID_12297
0.1160.0330.116ABCA1 expression enhancer

0.104 0.045 CID_12297

0.1050.0220.105Epoxide hydrolase inhibitor

0.075 0.048 CID_12297

0.0950.0120.095Phosphodiesterase 1C inhibitor
0.0880.0060.088Potassium channel (Inward rectifier) activator
0.0870.0050.087Nicotinic acid receptor agonist

0.066 0.01 CID_12297

0.1550.0730.155Protein-tyrosine phosphatase inhibitor

0.153 0.075 CID_12297

0.1390.0570.139Acetylcholine antagonist
0.0970.0160.097Androgen agonist

0.064 0.036 CID_12297

0.1060.0250.106Carbonic anhydrase V inhibitor
0.0860.0050.086Acetylcholine M4 receptor agonist
0.0880.0070.138Adenosine deaminase inhibitor

0.138 0.003 CID_12297

CID_12297
0.1120.0320.112Alpha 2d adrenoreceptor antagonist
0.0850.0050.085Potassium channel (ATP-sensitive) activator
0.1030.0240.103Carbonic anhydrase VA inhibitor
0.1250.0460.125Estrogen antagonist
0.0850.0060.085Kainate receptor 2 antagonist
0.1290.0490.129GABA receptor agonist
0.0920.0140.092Glycine transporter 2 inhibitor
0.090.0110.095MDM2 inhibitor

0.095 0.009 CID_12297

CID_12297
0.0830.0050.083Alpha 1d adrenoreceptor agonist
0.0830.0050.083Melatonin agonist
0.0810.0050.081Angiotensin AT2 receptor antagonist
0.1060.0290.106Myeloperoxidase inhibitor
0.1220.0460.122Butyrylcholinesterase inhibitor
0.0940.0190.0973-Oxoacyl-[acyl-carrier-protein] synthase inhibitor

0.097 0.018 CID_12297

CID_12297
0.2190.1440.219Caspase 3 stimulant

0.216 0.147 CID_12297

0.1220.0460.154Xanthine oxidase inhibitor

0.154 0.033 CID_12297

CID_12297
0.1510.0760.151Cholinergic
0.080.0060.08Immunoglobulin Fc receptor antagonist

0.08 0.006 CID_12297

0.0880.0140.088Histone deacetylase SIRT3 inhibitor

0.058 0.057 CID_12297

0.0790.0050.079Benzodiazepine antagonist
0.0780.0050.078Glutamate (mGluR3) antagonist

0.056 0.01 CID_12297

0.0780.0050.078Melatonin antagonist
0.0750.0030.09Lysophosphatidic acid receptor 1 agonist

0.09 0.002 CID_12297

CID_12297
0.080.0080.08Leukotriene C antagonist

0.08 0.008 CID_12297

0.1060.0340.106Bromodomain-containing protein 2 inhibitor
0.0920.020.092Acetylcholine M5 receptor antagonist

0.055 0.05 CID_12297

0.0950.0240.127Leukotriene antagonist

0.127 0.014 CID_12297

CID_12297
0.0760.0050.091Neuraminidase (Influenza A) inhibitor

0.091 0.004 CID_12297

CID_12297
0.0750.0040.0753-Hydroxyanthranilate 3,4-dioxygenase inhibitor

0.054 0.011 CID_12297

0.0830.0120.083Purinergic P2Y antagonist

0.083 0.012 CID_12297

0.0720.0020.077Lysophosphatidic acid receptor 3 agonist

0.077 0.002 CID_12297

CID_12297
0.0920.0220.092MAP kinase kinase 7 inhibitor

0.078 0.052 CID_12297

0.1390.0690.139Calcium channel blocker

0.12 0.087 CID_12297

0.0710.0020.071Carbonic anhydrase X inhibitor

0.057 0.002 CID_12297

0.0710.0020.071Carbonic anhydrase VIII inhibitor

0.057 0.002 CID_12297

0.0740.0050.074Purinergic P2Y12 antagonist

0.048 0.007 CID_12297

0.0960.0270.096Calcium channel L-type blocker

0.069 0.054 CID_12297

0.0710.0020.071Calcium-independent phospholipase A2 inhibitor

0.054 0.004 CID_12297

0.0840.0150.084Toll-Like receptor 8 antagonist
0.1870.1180.271Peptidyltransferase inhibitor

0.271 0.037 CID_12297

CID_12297
0.0970.0290.097Estrogen receptor alpha antagonist
0.1810.1120.181Glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase inhibitor
0.1190.050.119Alpha 2c adrenoreceptor antagonist
0.0810.0120.081Epithelial sodium channel blocker

0.056 0.036 CID_12297

0.0770.0090.077Glutamate (mGluR1a) antagonist

0.047 0.023 CID_12297

0.0720.0050.072Peptide deformylase inhibitor

0.033 0.018 CID_12297

0.0910.0240.101Secretase beta inhibitor

0.101 0.017 CID_12297

CID_12297
0.0720.0040.072Guanylate cyclase inhibitor

0.065 0.008 CID_12297

0.080.0130.08Potassium channel (Inward rectifier) blocker
0.0940.0270.094Neuronal nicotinic receptor antagonist
0.0820.0150.0823(or 17)beta-hydroxysteroid dehydrogenase inhibitor

0.081 0.016 CID_12297

0.0710.0040.071Histamine H1 receptor agonist
0.0710.0040.071Benzodiazepine receptor peripheral-type antagonist
0.0780.0120.078Prolactin release inhibitor
0.0820.0170.127Beta 1 adrenoreceptor antagonist

0.127 0.006 CID_12297

CID_12297
0.0790.0130.0795 Hydroxytryptamine 4 antagonist

0.05 0.038 CID_12297

0.0920.0260.092Phosphodiesterase VI inhibitor

0.088 0.03 CID_12297

0.0670.0020.067Vanilloid 2 agonist

0.047 0.003 CID_12297

0.0870.0220.128Beta adrenoreceptor antagonist

0.128 0.009 CID_12297

CID_12297
0.0870.0220.0875 Hydroxytryptamine 2A agonist
0.0720.0070.072Arginase inhibitor

0.069 0.008 CID_12297

0.0690.0050.069Glutamate (mGluR8) agonist

0.05 0.012 CID_12297

0.0720.0070.072Dopamine beta hydroxylase inhibitor

0.049 0.032 CID_12297

0.0840.020.084Phosphodiesterase 1B inhibitor
0.1780.1150.178Aryl hydrocarbon receptor agonist
0.0720.0090.127Phosphoglycerate kinase inhibitor

0.127 0.005 CID_12297

CID_12297
0.0670.0040.125Prostaglandin D2 agonist

0.125 0.002 CID_12297

CID_12297
0.0730.010.073Dihydroorotase inhibitor
0.0720.010.072Retinoid X receptor agonist

0.055 0.016 CID_12297

0.1010.0380.107Transcription factor NF kappa B stimulant

0.107 0.033 CID_12297

CID_12297
0.0740.0120.074Histone deacetylase 7 inhibitor
0.0930.0310.093Prostaglandin-E synthase inhibitor
0.080.0190.08Autotaxin inhibitor
0.0980.0380.139Adrenaline agonist

0.139 0.018 CID_12297

CID_12297
0.0780.0190.078Transcription factor RelA inhibitor
0.0640.0040.064Angiotensin AT1 receptor antagonist

0.057 0.008 CID_12297

0.0640.0050.106ATP citrate lysase inhibitor

0.106 0.003 CID_12297

CID_12297
0.0660.0070.066Potassium channel Kv1.1 blocker
0.0650.0060.065Melatonin 1 agonist
0.0640.0040.064Vanilloid 3 antagonist

0.044 0.014 CID_12297

0.0750.0160.0755 Hydroxytryptamine 7 agonist
0.0650.0060.0652,3-Oxidosqualene-lanosterol cyclase inhibitor

0.043 0.017 CID_12297

0.0730.0150.073Dihydroorotate oxidase inhibitor

0.051 0.049 CID_12297

0.0660.0080.066Purinergic P2T antagonist
0.0840.0250.084Protein kinase C beta inhibitor
0.0690.0110.069Glutamate (mGluR4) antagonist
0.0740.0170.074Histamine agonist
0.0620.0040.062Angiotensin II receptor antagonist

0.049 0.007 CID_12297

0.0780.0210.085Thromboxane antagonist

0.085 0.017 CID_12297

CID_12297
0.0670.010.067Retinoid X alpha receptor agonist

0.036 0.023 CID_12297

0.0620.0050.062Retinoid X receptor antagonist

0.044 0.018 CID_12297

0.0750.0170.075Lipocortins synthesis agonist

0.058 0.039 CID_12297

0.0610.0040.061Epoxide hydrolase 1 inhibitor
0.0710.0140.081Adenine nucleotide translocase inhibitor

0.081 0.008 CID_12297

CID_12297
0.0730.0160.073Thromboxane synthase inhibitor

0.071 0.017 CID_12297

0.0960.0390.096NAD(P)H dehydrogenase (quinone) inhibitor

0.08 0.051 CID_12297

0.0950.0380.095Macrophage migration inhibitory factor inhibitor
0.0760.020.076Antimetabolite

0.069 0.022 CID_12297

0.0610.0050.061Leukotriene B4 receptor 1 antagonist

0.058 0.005 CID_12297

0.0670.0110.067Oxytocin agonist

0.049 0.024 CID_12297

0.0810.0260.0815 Hydroxytryptamine 3 agonist
0.0820.0260.1Ribonucleotide reductase inhibitor

0.1 0.021 CID_12297

CID_12297
0.070.0140.07Aldosterone antagonist

0.054 0.025 CID_12297

0.0580.0030.058Acid ceramidase inhibitor

0.034 0.005 CID_12297

0.080.0250.099Ribonucleoside-diphosphate reductase inhibitor

0.099 0.019 CID_12297

CID_12297
0.070.0150.07HCV NS3/NS4A protease inhibitor

0.051 0.03 CID_12297

0.0580.0030.058Purinergic P2Y15 antagonist

0.045 0.005 CID_12297

0.0650.010.065GABA B receptor antagonist

0.051 0.019 CID_12297

0.0730.0180.073Plasminogen activator inhibitor antagonist
0.060.0040.06Glutamate (mGluR1a) agonist
0.060.0050.06Corticotropin releasing factor 1 receptor antagonist
0.070.0150.07Prolyl endopeptidase inhibitor
0.0580.0030.058Nicotinic acid receptor 2 antagonist

0.035 0.008 CID_12297

0.0710.0160.081Beta 2 adrenoreceptor antagonist

0.081 0.012 CID_12297

CID_12297
0.0630.0090.063Sirtuin 2 inhibitor
0.0730.0190.078Thromboxane A2 antagonist

0.078 0.016 CID_12297

CID_12297
0.0640.0110.086Sphingosine 1-phosphate receptor 1 agonist

0.086 0.005 CID_12297

CID_12297
0.1190.0650.119Calcium channel N-type blocker
0.1740.120.219Free radical scavenger

0.219 0.084 CID_12297

CID_12297
0.1010.0470.101Potassium channel activator
0.0570.0040.086Prostaglandin F2 alpha agonist

0.086 0.002 CID_12297

CID_12297
0.0660.0130.09Sphingosine 1-phosphate receptor agonist

0.09 0.007 CID_12297

CID_12297
0.0720.0190.095Leukotriene B4 antagonist

0.095 0.012 CID_12297

CID_12297
0.0570.0040.057Adenosine uptake inhibitor
0.0760.0230.076Heat shock protein 90 beta antagonist
0.130.0770.13Toll-Like receptor 9 antagonist
0.0620.0090.062GABA uptake inhibitor

0.045 0.019 CID_12297

0.0710.0180.071Beta 2 adrenoreceptor agonist

0.071 0.017 CID_12297

0.1260.0730.126Acetylcholinesterase inhibitor
0.0580.0060.058Uridine phosphorylase inhibitor

0.058 0.006 CID_12297

0.0640.0110.064Glutamate (mGluR group III) antagonist
0.0820.030.099Peroxisome proliferator-activated receptor gamma antagonist

0.099 0.016 CID_12297

CID_12297
0.1020.050.102Potassium channel (Voltage-sensitive) activator
0.0890.0380.089Histone deacetylase SIRT2 inhibitor
0.0560.0050.056Ceramide glucosyltransferase inhibitor

0.043 0.013 CID_12297

0.0770.0260.077Alpha 2 adrenoreceptor agonist
0.0710.020.071Carbonic anhydrase XIV inhibitor

0.047 0.036 CID_12297

0.0780.0270.078NMDA 2C receptor antagonist
0.0540.0030.054Hedgehog signaling activator

0.047 0.004 CID_12297

0.1280.0770.128Alkaline phosphatase inhibitor
0.080.0290.08Acetylcholine M2 receptor antagonist
0.0590.0090.218Prostaglandin agonist

0.218 0.003 CID_12297

CID_12297
0.0650.0150.0655-Alpha-reductase inhibitor
0.0650.0150.065Fructose-1,6-bisphosphatase inhibitor
0.0560.0060.056Melatonin receptor 1A agonist
0.1440.0940.144Heat shock protein 90 alpha antagonist
0.0610.0110.061Dihydropteroate synthase inhibitor
0.0640.0140.064Kainate receptor antagonist
0.0660.0160.066Heparanase inhibitor

0.055 0.033 CID_12297

0.0540.0050.054Melatonin 1 antagonist
0.0660.0170.066Nicotinic receptor alpha3 subunit antagonist
0.0820.0330.082Sirtuin 1 inhibitor

0.066 0.05 CID_12297

0.060.0120.06Plasmepsin II inhibitor

0.057 0.013 CID_12297

0.0530.0050.053Retinoid X alpha receptor antagonist

0.038 0.017 CID_12297

0.0560.0070.056Leukotriene C4 antagonist

0.054 0.008 CID_12297

0.0690.0210.069Bcl-xL inhibitor
0.0530.0050.053Glutamate (mGluR1) agonist

0.03 0.009 CID_12297

0.0550.0070.055Free fatty acid receptor 1 antagonist

0.032 0.027 CID_12297

0.1610.1130.161Focal adhesion kinase 2 inhibitor
0.0640.0160.064Leukocyte elastase inhibitor
0.0560.0080.056Heme oxygenase inhibitor

0.047 0.017 CID_12297

0.0590.0110.059Nicotinic acid receptor 2 agonist
0.0770.0290.077Adenosine A1 receptor antagonist
0.0590.0120.059Histone deacetylase 9 inhibitor
0.060.0140.06Thymidine kinase inhibitor

0.055 0.016 CID_12297

0.0710.0240.071NMDA 2A receptor antagonist
0.1140.0670.125Protein-tyrosine phosphatase 1B inhibitor

0.125 0.059 CID_12297

CID_12297
0.0560.010.056Potassium channel subfamily K member 3 blocker
0.0530.0080.0531-Alkyl-2-acetylglycerophosphocholine esterase inhibitor

0.045 0.012 CID_12297

0.050.0040.05Elastase 2B inhibitor
0.050.0040.05Elastase 3A inhibitor
0.050.0040.05Elastase 3B inhibitor
0.0520.0060.052Kainate receptor 4 antagonist
0.0510.0060.054Methionyl aminopeptidase 1 inhibitor

0.054 0.005 CID_12297

CID_12297
0.0660.0210.073Bombesin 2 receptor antagonist

0.073 0.019 CID_12297

CID_12297
0.1990.1530.199Hypoxia-inducible factor 1 alpha inhibitor
0.050.0050.05Elastase 2 inhibitor
0.050.0050.05Elastase 2A inhibitor
0.0480.0040.048Toll-Like receptor 8 agonist

0.038 0.004 CID_12297

0.0930.0490.093Acetylcholine M3 receptor agonist
0.0840.040.0845 Hydroxytryptamine 1F antagonist
0.0670.0230.09Peroxisome proliferator-activated receptor alpha agonist

0.09 0.015 CID_12297

CID_12297
0.1540.110.232P-glycoprotein inhibitor

0.232 0.048 CID_12297

CID_12297
0.1440.1010.261Nitric oxide antagonist

0.261 0.049 CID_12297

CID_12297
0.0720.0290.072Glutamate (mGluR1) antagonist
0.0560.0130.06Squalene synthetase inhibitor

0.06 0.012 CID_12297

CID_12297
0.0620.020.062Dopamine D2 agonist
0.0470.0050.047Glutamate (mGluR3) agonist

0.036 0.015 CID_12297

0.0480.0060.109Prostaglandin EP2 agonist

0.109 0.003 CID_12297

CID_12297
0.0550.0140.079Sphingosine 1-phosphate receptor 3 agonist

0.079 0.009 CID_12297

CID_12297
0.0450.0040.045Glucosylceramidase stimulant
0.050.0090.05AMPA 3 receptor antagonist
0.110.0690.11Nav1.5 sodium channel blocker
0.0530.0130.053Diamine oxidase inhibitor
0.0440.0050.044Protease (Human cytomegalovirus) inhibitor
0.0960.0560.096Protein kinase C zeta inhibitor
0.0480.0090.048Hypoxanthine phosphoribosyltransferase inhibitor

0.043 0.011 CID_12297

0.0870.0480.087Acetylcholine nicotinic agonist
0.1090.0710.109Calcium channel (voltage-sensitive) blocker
0.0410.0030.057Neuraminidase (Influenza B) inhibitor

0.057 0.002 CID_12297

CID_12297
0.0430.0040.043Estrogen-related receptor gamma antagonist

0.03 0.015 CID_12297

0.0690.0310.069Cathepsin L inhibitor
0.070.0320.088Nitric oxide donor

0.088 0.016 CID_12297

CID_12297
0.0550.0170.055Dopamine D3 agonist
0.0910.0530.132ATPase (Vacuolar H+) inhibitor

0.132 0.013 CID_12297

CID_12297
0.0580.020.058NMDA receptor subunit 3B antagonist
0.0710.0330.071Aromatase inhibitor
0.0890.0520.105Hematopoietic

0.105 0.031 CID_12297

CID_12297
0.0680.0310.068Cyclin D1 inhibitor
0.0430.0060.043Nicotinic alpha4beta2 receptor agonist
0.0550.0180.055AICAR transformylase inhibitor

0.04 0.038 CID_12297

0.0630.0260.063Nicotinic receptor alpha7 subunit antagonist
0.040.0040.04Ileal bile acid transport inhibitor

0.035 0.004 CID_12297

0.060.0240.06Carbonic anhydrase II stimulant
0.0480.0120.048Histone deacetylase 10 inhibitor
0.0660.030.066Botulinum neurotoxin type A inhibitor

0.061 0.036 CID_12297

0.0520.0170.052Dihydrofolate reductase inhibitor
0.0730.0380.073Histone deacetylase inhibitor
0.0390.0040.039Thyroid hormone alpha antagonist
0.0790.0440.079Metalloproteinase-9 inhibitor

0.07 0.055 CID_12297

0.1420.1070.142LIM domain kinase 1 inhibitor
0.0660.0320.066Potassium channel (Ca-activated) blocker
0.0480.0140.048Histone deacetylase class IV inhibitor
0.0480.0140.048Histone deacetylase 11 inhibitor
0.0450.0110.045Dipeptidyl peptidase II inhibitor
0.0840.050.084Ca(v)3.1 blocker
0.050.0160.05Cholecystokinin B agonist
0.0640.0310.064Cyclin A1 inhibitor
0.0440.0110.044Liver X receptor beta antagonist
0.0490.0160.049Factor XIIIa inhibitor
0.0450.0130.045Melatonin 2 agonist
0.0490.0160.049Vascular adhesion protein 1 inhibitor
0.0590.0260.059H+/K+-transporting ATPase inhibitor
0.0360.0040.036Isoleucine-tRNA ligase inhibitor

0.035 0.004 CID_12297

0.050.0180.05Nerve growth factor antagonist
0.0540.0230.054CC chemokine 4 receptor antagonist
0.0360.0050.036Angiotensin AT1A receptor antagonist
0.0430.0120.043Glucagon receptor antagonist

0.041 0.013 CID_12297

0.0370.0060.045Toll-Like receptor 4 agonist

0.045 0.004 CID_12297

CID_12297
0.0880.0570.088Antineoplastic alkaloid
0.0540.0230.054Thymidylate synthase inhibitor
0.0360.0050.121Prostacyclin agonist

0.121 0.003 CID_12297

CID_12297
0.0630.0330.063Cathepsin B inhibitor
0.1480.1170.148Pyruvate kinase inhibitor
0.0350.0050.035Complement factor 1s inhibitor
0.0360.0060.0361,3-Beta-glucan synthase inhibitor

0.031 0.012 CID_12297

0.0650.0350.065Cyclin-dependent kinase 6 inhibitor
0.0350.0050.035Lysophosphatidic acid 1 receptor antagonist

0.034 0.005 CID_12297

0.040.010.04Cathepsin K inhibitor
0.0410.0120.057Cholesterol ester transfer protein antagonist

0.057 0.005 CID_12297

CID_12297
0.0330.0030.04Thromboxane A2 agonist

0.04 0.002 CID_12297

CID_12297
0.0570.0270.057Adenosine A2b receptor antagonist
0.0610.0320.061Matrix metalloproteinase (membrane-type) inhibitor

0.051 0.044 CID_12297

0.0330.0040.033Retinoid X beta receptor antagonist

0.023 0.009 CID_12297

0.0460.0170.046MAP3K5 inhibitor
0.0320.0030.0321-Deoxy-D-xylulose-5-phosphate reductoisomerase inhibitor

0.013 0.009 CID_12297

0.0980.0690.098Estrogen receptor beta antagonist
0.0710.0430.071Matrix metalloproteinase inhibitor
0.0360.0080.036Thymidine phosphorylase inhibitor

0.026 0.019 CID_12297

0.0560.0270.056Metalloproteinase-3 inhibitor
0.0430.0140.043Estradiol 17 beta-dehydrogenase 3 inhibitor
0.0840.0560.084GABA A receptor agonist
0.0360.0080.036Kainate receptor 1 antagonist
0.0450.0170.0455 Hydroxytryptamine 2B agonist
0.0350.0060.116Prostaglandin EP4 agonist

0.116 0.003 CID_12297

CID_12297
0.0390.0110.044Lysine carboxypeptidase inhibitor

0.044 0.009 CID_12297

CID_12297
0.0510.0230.051Potassium channel small-conductance Ca-activated blocker
0.0340.0070.04Leukotriene B4 receptor 2 antagonist

0.04 0.005 CID_12297

CID_12297
0.0390.0110.039Nicotinic alpha3beta4 receptor agonist
0.0810.0530.081Chymotrypsin inhibitor
0.0420.0140.042AMPA 1 receptor antagonist
0.0460.0180.055Calcitonin receptor agonist

0.055 0.016 CID_12297

CID_12297
0.0410.0130.041Endothelial nitric-oxide synthase inhibitor
0.0320.0040.032Nicotinic acid receptor 1 antagonist

0.016 0.014 CID_12297

0.0360.0080.16Prostaglandin E2 agonist

0.16 0.003 CID_12297

CID_12297
0.1310.1040.131MAP kinase 3 inhibitor
0.080.0520.08Metalloproteinase-2 inhibitor
0.0440.0170.044Histone deacetylase 2 inhibitor
0.040.0130.04Carboxypeptidase B inhibitor

0.04 0.013 CID_12297

0.0640.0370.064Acetylcholine M3 receptor antagonist
0.0630.0360.089Cathepsin E inhibitor

0.089 0.018 CID_12297

CID_12297
0.0820.0560.082Thioredoxin reductase inhibitor
0.0290.0030.029Carbonic anhydrase XI inhibitor

0.018 0.005 CID_12297

0.090.0640.09Potassium channel (Ca-activated) activator
0.0320.0060.032Imidazoline I1 receptor antagonist
0.1180.0920.118Cytokine production inhibitor
0.0410.0150.041Carnitine palmitoyltransferase inhibitor
0.0410.0160.041Glutamate (mGluR8) antagonist
0.0650.040.065Adenosine A2a receptor antagonist
0.0290.0030.029Telomerase stimulant

0.024 0.005 CID_12297

0.0370.0130.037Leukotriene D4 antagonist

0.033 0.014 CID_12297

0.0340.0090.034Myristoyl transferase inhibitor
0.0760.0510.076Alpha 2a adrenoreceptor antagonist
0.040.0150.04Carnitine palmitoyltransferase 1 inhibitor
0.0530.0290.053CD45 antagonist

0.046 0.044 CID_12297

0.0920.0680.092MAP kinase kinase 1 inhibitor

0.086 0.077 CID_12297

0.0580.0340.058GABA receptor antagonist
0.0340.010.034Sodium/glucose cotransporter 2 inhibitor

0.034 0.01 CID_12297

0.0460.0230.046Neurokinin 2 agonist
0.0360.0130.036Histone deacetylase 3 inhibitor
0.0460.0220.046Cathepsin L1 inhibitor
0.0520.0290.052Glutamate (mGluR group I) agonist
0.0470.0240.047Histone deacetylase 8 inhibitor
0.0320.0090.032Thymidine kinase (Herpes simplex virus 1) inhibitor

0.029 0.013 CID_12297

0.1260.1030.126Heat shock protein 90 antagonist
0.0440.0220.044Melanocortin 1 antagonist

0.038 0.026 CID_12297

0.0320.010.033Sodium/glucose cotransporter inhibitor

0.033 0.009 CID_12297

CID_12297
0.0250.0030.046Thromboxane agonist

0.046 0.002 CID_12297

CID_12297
0.0470.0250.058Beta adrenoreceptor agonist

0.058 0.009 CID_12297

CID_12297
0.0660.0440.066Neutrophil collagenase inhibitor
0.0650.0440.065Adenosine A2 receptor antagonist
0.0280.0060.028Retinoic acid beta receptor agonist
0.0480.0270.048Phosphodiesterase 6C inhibitor
0.0650.0440.065Dopamine D1 antagonist
0.0290.0080.029Fructose-1,6-bisphosphatase 1 inhibitor
0.0390.0180.049Peroxisome proliferator-activated receptor delta agonist

0.049 0.013 CID_12297

CID_12297
0.0550.0350.055Matrix metalloproteinase 1 inhibitor
0.0440.0230.044NMDA receptor subunit 3A antagonist
0.0430.0230.043G protein-coupled receptor agonist

0.038 0.026 CID_12297

0.0280.0090.0285 Hydroxytryptamine 4 agonist
0.0290.0090.0295-Alpha-reductase 2 inhibitor
0.0310.0120.031Prostaglandin H2 antagonist

0.023 0.02 CID_12297

0.0280.0090.0285-Alpha-reductase 1 inhibitor
0.0590.0390.059Calcium channel T-type blocker
0.0550.0350.055GABA A receptor antagonist
0.0240.0050.024Methylmalonyl-CoA mutase inhibitor

0.024 0.004 CID_12297

0.0240.0050.024NMDA receptor phencyclidine site antagonist
0.0310.0120.031Thyroid hormone agonist
0.0250.0060.025Alpha 2b adrenoreceptor agonist
0.0240.0050.024Purinergic P2Y1 agonist

0.018 0.008 CID_12297

0.0230.0050.023Angiotensin AT1B receptor antagonist
0.0610.0430.0615 Hydroxytryptamine 5A antagonist
0.0820.0640.082Alpha 2 adrenoreceptor antagonist
0.0230.0050.023Granulocyte colony stimulating factor receptor agonist
0.0580.040.058Xanthine dehydrogenase inhibitor
0.0430.0250.043Nicotinic acid receptor 1 agonist
0.0580.040.058Dopamine uptake inhibitor
0.0480.030.048Carbonic anhydrase VII inhibitor
0.0440.0260.044CDK5/p25 inhibitor
0.0250.0070.025Thymidine kinase (Herpes simplex virus 2) inhibitor

0.021 0.014 CID_12297

0.0550.0380.055Human rhinovirus A protease inhibitor
0.0770.060.077Histamine H1 receptor antagonist
0.0410.0240.041Glutamate (mGluR group II) antagonist
0.0250.0080.025Factor XIII inhibitor
0.0260.0090.057Vitamin D receptor antagonist

0.057 0.004 CID_12297

CID_12297
0.0360.0190.036Liver X receptor beta agonist
0.0230.0060.025Antibiotic Anthracycline-like

0.025 0.005 CID_12297

CID_12297
0.0310.0150.063Prostaglandin EP4 antagonist

0.063 0.007 CID_12297

CID_12297
0.0360.020.036Histone deacetylase 4 inhibitor
0.0270.0110.027Kainate receptor 5 antagonist
0.0190.0030.019Angiotensin AT2 receptor agonist
0.0460.0310.046Glutamate (mGluR5) agonist
0.030.0140.03Epoxide hydrolase 2 inhibitor
0.0370.0210.037Glucose-dependent insulinotropic receptor agonist
0.0740.0590.074Glutamate receptor agonist
0.030.0150.03Baculoviral IAP repeat-containing protein 4 inhibitor
0.0210.0060.031Vitamin D receptor agonist

0.031 0.004 CID_12297

CID_12297
0.040.0260.04Urate transporter 1 inhibitor
0.0220.0080.022Estrogen-related receptor gamma agonist
0.0330.0180.061Plasmepsin I inhibitor

0.061 0.005 CID_12297

CID_12297
0.0680.0540.068NMDA 2 receptor antagonist
0.0580.0440.058Collagenase 3 inhibitor
0.0180.0040.018Corticotropin releasing factor antagonist
0.0330.020.033Potassium channel small-conductance Ca-activated activator
0.0350.0220.035Histone deacetylase 5 inhibitor
0.0180.0040.018Melatonin 2 antagonist
0.0390.0250.042Farnesoid X receptor agonist

0.042 0.021 CID_12297

CID_12297
0.0190.0060.019Melatonin receptor 1A antagonist
0.020.0070.02Nicotinic alpha4 receptor agonist
0.0530.040.053Lysine-specific demethylase 1A inhibitor
0.0270.0140.027Dopamine autoreceptor agonist
0.0210.0080.021CXC chemokine 5 receptor antagonist
0.0480.0360.048Topoisomerase II beta inhibitor
0.0310.0180.0315 Hydroxytryptamine 1D agonist
0.0170.0050.017Cyclin D2 inhibitor
0.0470.0340.047AMPA receptor antagonist
0.0210.0080.021Kainate receptor 3 antagonist
0.0170.0050.017Glutamate (mGluR6) agonist

0.011 0.01 CID_12297

0.0280.0160.028CXC chemokine 2 receptor antagonist
0.0420.030.042Carbonic anhydrase IV inhibitor
0.0930.0810.093Beta glucuronidase inhibitor
0.0510.040.051Dipeptidyl peptidase inhibitor
0.0490.0380.049Diacylglycerol O-acyltransferase inhibitor
0.0360.0250.036Tryptophan 5 hydroxylase inhibitor
0.0210.010.021Aminopeptidase A inhibitor

0.021 0.01 CID_12297

0.0150.0050.015Imidazoline I2 receptor antagonist
0.0410.030.041Acetyl-CoA carboxylase inhibitor
0.0210.0110.021Caspase 8 inhibitor

0.019 0.015 CID_12297

0.0190.0080.019Adenosine A2a receptor agonist
0.0630.0520.0635 Hydroxytryptamine 3A antagonist
0.030.020.03AMPA 2 receptor antagonist
0.0850.0750.085MAO A inhibitor
0.020.0090.02Alpha 2a adrenoreceptor agonist
0.0450.0350.045Glycine transporter inhibitor
0.020.010.02Alpha 2c adrenoreceptor agonist
0.0240.0140.024Retinoic acid receptor agonist
0.0430.0330.043Dipeptidyl peptidase IV inhibitor
0.0290.0190.029Thrombin receptor antagonist
0.040.030.04Liver X receptor alpha agonist
0.0180.0090.018Adenosine A2 receptor agonist
0.0190.010.019Potassium channel (Inward rectifier) 11 blocker
0.0190.010.021G-protein-coupled receptor 120 agonist

0.021 0.008 CID_12297

CID_12297
0.0370.0280.037TRPM8 blocker
0.0660.0570.066Benzodiazepine agonist
0.0350.0270.035Delayed rectifier potassium channel activator
0.0350.0270.035Potassium channel KCNQ activator
0.0270.0190.027Retinoid X gamma receptor antagonist
0.0330.0260.07HMG CoA reductase inhibitor

0.07 0.004 CID_12297

CID_12297
0.0270.0190.02911-Beta-hydroxysteroid dehydrogenase 2 inhibitor

0.029 0.018 CID_12297

CID_12297
0.050.0420.05Elastase inhibitor
0.0480.040.0485 Hydroxytryptamine 2 agonist
0.0540.0470.0545 Hydroxytryptamine 5 antagonist
0.0440.0360.044Parathyroid hormone antagonist
0.180.1720.18Prostaglandin dehydrogenase inhibitor
0.0190.0120.019Histamine H4 receptor agonist
0.1310.1240.131Amyloid beta aggregation inhibitor
0.0610.0540.061Kallikrein 7 inhibitor
0.0830.0760.083Polo-like kinase-1 inhibitor
0.0230.0160.023CC chemokine 8 receptor antagonist
0.0230.0160.023ICAM 1 antagonist
0.0190.0120.019Cyclin T1 inhibitor
0.0220.0150.022Geranylgeranyltransferase inhibitor
0.0240.0180.024Histone deacetylase 1 inhibitor
0.0210.0150.021Glutaminyl-peptide cyclotransferase inhibitor
0.0240.0190.024Methionyl aminopeptidase 2 inhibitor
0.0280.0230.028Glutamate (mGluR2) antagonist
0.0510.0460.064Angiotensin-converting enzyme inhibitor

0.064 0.025 CID_12297

CID_12297
0.0570.0520.0575 Hydroxytryptamine 1D antagonist
0.0280.0240.028MAP3K8 inhibitor
0.0240.020.024Histone deacetylase class IIb inhibitor
0.0290.0240.029Histone deacetylase class IIa inhibitor
0.0590.0550.059Aryl hydrocarbon receptor antagonist
0.0640.0590.064Phosphodiesterase V inhibitor
0.0450.0410.045Histamine H4 receptor antagonist
0.0360.0310.036Histone deacetylase class I inhibitor
0.0320.0280.032Progesterone antagonist
0.0510.0480.051MAP kinase kinase 9 inhibitor
0.0230.020.023Histone deacetylase 6 inhibitor
0.0310.0270.031Vanilloid 4 antagonist
0.0750.0720.077NMDA receptor antagonist

0.077 0.069 CID_12297

CID_12297
0.0270.0230.027RNA-directed RNA polymerase stimulant
0.0450.0420.045CC chemokine receptor 2B antagonist
0.0920.0890.092Factor V inhibitor
0.0490.0460.049CC chemokine 2 receptor antagonist
0.0260.0230.026LFA antagonist
0.0140.0110.014CXC chemokine 4 receptor agonist
0.0080.0050.008DNA topoisomerase III inhibitor
0.0260.0230.026Histone deacetylase class II inhibitor
0.0330.0310.033Nicotinic receptor beta4 subunit antagonist
0.0070.0040.007Integrin alpha5beta6 antagonist
0.0420.040.042Purinergic P2X4 antagonist
0.0590.0570.059Alpha adrenoreceptor agonist
0.0120.0110.012Human herpes virus 5 capsid protein P40 inhibitor
0.0310.030.031Protein kinase (CK2) beta inhibitor
0.0260.0250.0265 Hydroxytryptamine 6 agonist
0.0460.0450.144Neuropeptide agonist

0.144 0.015 CID_12297

CID_12297
0.0730.0720.073Neuropeptide Y antagonist
0.0170.0160.017Complement factor D inhibitor
0.0820.0830.149Protease inhibitor

0.149 0.03 CID_12297

CID_12297
0.0170.0170.019Peroxisome proliferator-activated receptor alpha antagonist

0.019 0.016 CID_12297

CID_12297
0.0360.0380.037Glucagon-like peptide 1 receptor antagonist

0.037 0.033 CID_12297

CID_12297
0.030.0320.037Peroxisome proliferator-activated receptor delta antagonist

0.037 0.017 CID_12297

CID_12297
0.0260.0290.037DNA polymerase III inhibitor

0.037 0.006 CID_12297

CID_12297
0.0440.050.129Cathepsin D inhibitor

0.129 0.01 CID_12297

CID_12297
0.0190.0240.025Beta 1 adrenoreceptor agonist

0.025 0.013 CID_12297

CID_12297
0.0340.040.055Growth hormone release inhibitor

0.055 0.018 CID_12297

CID_12297
0.050.0570.089Glucagon-like peptide 1 agonist

0.089 0.028 CID_12297

CID_12297
0.20.2070.319Antiobesity

0.319 0.104 CID_12297

CID_12297
0.0280.040.052p53 inhibitor

0.052 0.013 CID_12297

CID_12297
0.1070.1230.175Papain-like protease (SARS coronavirus) inhibitor

0.175 0.018 CID_12297

CID_12297
0.0030.020.016DNA polymerase III subunit alpha inhibitor

0.016 0.002 CID_12297

CID_12297
0.0050.0240.012Beta 3 adrenoreceptor agonist

0.012 0.008 CID_12297

CID_12297
0.010.0320.015DNA polymerase III polC-type inhibitor

0.015 0.006 CID_12297

CID_12297
0.0290.0510.056Endothelin-converting enzyme inhibitor

0.056 0.026 CID_12297

CID_12297
0.0270.050.038Antibiotic Aminoglycoside-like

0.038 0.023 CID_12297

CID_12297
0.0540.0780.197Antineoplastic antibiotic

0.197 0.022 CID_12297

CID_12297
0.0190.0440.108Renin inhibitor

0.108 0.005 CID_12297

CID_12297
0.0110.0380.026Human T-cell leukemia virus type I protease inhibitor

0.026 0.01 CID_12297

CID_12297
0.0080.0450.017Calcium-sensing receptor antagonist

0.017 0.009 CID_12297

CID_12297
0.0150.0540.048Prostacyclin antagonist

0.048 0.014 CID_12297

CID_12297
0.0130.0560.05Prostaglandin EP3 antagonist

0.05 0.01 CID_12297

CID_12297
0.0310.0750.049Protein 50S ribosomal subunit inhibitor

0.049 0.041 CID_12297

CID_12297
0.0290.0850.048Microtubule stabilization

0.048 0.03 CID_12297

CID_12297
0.0220.0850.064HIV-1 protease inhibitor

0.064 0.01 CID_12297

CID_12297
0.0710.1370.167Interleukin 12 antagonist

0.167 0.009 CID_12297

CID_12297
0.1710.2420.205Toll-Like receptor 7 agonist

0.205 0.194 CID_12297

CID_12297
0.2010.2750.597Cyclophilin D inhibitor

0.597 0.028 CID_12297

CID_12297
0.0080.0890.022Aminopeptidase P inhibitor

0.022 0.018 CID_12297

CID_12297
0.0770.1840.211Interleukin 1 antagonist

0.211 0.028 CID_12297

CID_12297
0.0420.1520.091Somatostatin 1 agonist

0.091 0.041 CID_12297

CID_12297
0.0540.2160.207Interleukin 1b antagonist

0.207 0.018 CID_12297

CID_12297
0.0990.30.173Growth factor agonist

0.173 0.097 CID_12297

CID_12297
0.0260.2640.113Antiadrenergic

0.113 0.049 CID_12297

CID_12297
0.0250.2640.111Adrenaline antagonist

0.111 0.048 CID_12297

CID_12297
0.0510.3180.125MAP3K9 inhibitor

0.125 0.104 CID_12297

CID_12297
0.0480.3280.0823C-Like protease (SARS coronavirus) inhibitor

0.082 0.062 CID_12297

CID_12297
00.5310.014Mannitol 2-dehydrogenase inhibitor

0.014 0.003 CID_12297

CID_12297
Ext Pa Pi Pmax Activity Other Results ID Pa_max